Common name
6-chloroquinoxaline
IUPAC name
6-chloroquinoxaline
SMILES
c1nc2c(nc1)cc(cc2)Cl
Common name
6-chloroquinoxaline
IUPAC name
6-chloroquinoxaline
SMILES
c1nc2c(nc1)cc(cc2)Cl
INCHI
InChI=1S/C8H5ClN2/c9-6-1-2-7-8(5-6)11-4-3-10-7/h1-5H
FORMULA
C8H5ClN2
Common name
6-chloroquinoxaline
IUPAC name
6-chloroquinoxaline
Molecular weight
164.592
clogP
2.616
clogS
-3.178
Frequency
0.0014
HBond Acceptor
2
HBond Donor
0
Total PolarSurface Area
25.78
Number of Rings
2
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD02651 | kuicaoxi |
|
Herbicide | Herbicide |
| FDBD02652 | propaquizafop |
|
Herbicide | Herbicide |
| FDBD02653 | quizalofop |
|
Herbicide | Herbicide |
| FDBD02654 | quizalofop-P |
|
Herbicide | Herbicide |
4 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1cet_ligand_1_0.mol2 | 1cet | 0.717391 | -7.17 | Nc1c2c(ncc1)cc(cc2)Cl | 12 |
| 2aou_ligand_1_0.mol2 | 2aou | 0.717391 | -7.05 | Nc1c2ccc(cc2ncc1)Cl | 12 |
| 4fgz_ligand_1_0.mol2 | 4fgz | 0.717391 | -5.85 | Nc1c2ccc(cc2ncc1)Cl | 12 |
| 3fue_ligand.mol2 | 3fue | 0.697674 | -7.26 | c1cc2cc(ccc2[nH]1)Cl | 11 |
| 2a5u_ligand_frag_0.mol2 | 2a5u | 0.675 | -6.81 | c1cccc2c1nccn2 | 10 |
| 4bdc_ligand_frag_1.mol2 | 4bdc | 0.675 | -6.80 | n1c2ccccc2ncc1 | 10 |
| 4bdk_ligand_frag_1.mol2 | 4bdk | 0.675 | -6.78 | c1ccc2c(c1)nccn2 | 10 |
113 ,
12
